Compound Identification
SMILES
CC1=CC(C)=C(N\C=C2\C(=O)N(C(=O)C3=CC=CC=C23)C2=CC(Cl)=CC=C2)C=C1
InChIKey
InChIKey=OUWQXSQSNKHXMD-KGENOOAVSA-N
Formula
C24H19ClN2O2
Mass
402.88
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Isoquinolines and derivatives
- Subclass 1,3-isoquinolinediones
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Class
Isoquinolines and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoquinolines and derivatives
Subclass
1,3-isoquinolinediones
Intermediate Tree Nodes
Not available
Direct Parent
1,3-isoquinolinediones
Alternative Parents
Isoquinolones and derivatives Tetrahydroisoquinolines m-Xylenes Aniline and substituted anilines Secondary alkylarylamines Chlorobenzenes N-substituted carboxylic acid imides Aryl chlorides Vinylogous amides Dicarboximides Amino acids and derivatives Enamines Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-isoquinolinedione - Isoquinolone - Tetrahydroisoquinoline - M-xylene - Xylene - Aniline or substituted anilines - Halobenzene - Chlorobenzene - Secondary aliphatic/aromatic amine - Benzenoid - Aryl chloride - Carboxylic acid imide, n-substituted - Aryl halide - Monocyclic benzene moiety - Carboxylic acid imide - Dicarboximide - Vinylogous amide - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Secondary amine - Enamine - Organooxygen compound - Organic oxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1,3-isoquinolinediones. These are isoquinoline derivatives carrying one C=O group at positions 1, and 3 respectively.
External Descriptors
Not available